51216-58-1

Basic information

• Product Name: 3-(pyridin-3-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one
• Synonyms: 4-thiazolidinone, 3-(3-pyridinylmethyl)-2-thioxo-; Thiazolidin-4-one, 3-pyridin-3-ylmethyl-2-thioxo-
• CAS NO: 51216-58-1
• Molecular Formula: C₉H₈N₂OS₂
• Molecular Weight: 224.3026
• Mol File: 51216-58-1.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 385.5°C at 760 mmHg
• Flash Point: 187°C
• Density: 1.46g/cm³
• Vapor Pressure: 3.78E-06mmHg at 25°C
• Refractive Index: 1.715
• CAS DataBase Reference: 3-(pyridin-3-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(pyridin-3-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one(51216-58-1)
• EPA Substance Registry System: 3-(pyridin-3-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one(51216-58-1)

Safety Data

• Hazardous Substances Data: 51216-58-1(Hazardous Substances Data)

Upstream product

• 36810-90-9 3-(isothiocyanatomethyl)pyridine 
• 2365-48-2 Methyl thioglycolate 
• 3731-53-1 4-(aminomethyl)pyridine 
• 6326-83-6 bis(carboxymethyl)trithiocarbonate 

Relevant articles and documents

Discovery and optimization of 4-oxo-2-thioxo-thiazolidinones as NOD-like receptor (NLR) family, pyrin domain-containing protein 3 (NLRP3) inhibitors

Aberrant activation of NLRP3 inflammasome is present in a subset of acute and chronic inflammatory diseases. The NLRP3 inflammasome has been recognized as an attractive therapeutic target for developing novel and specific anti-inflammatory inhibitors. Cellular structure-activity relationship-guided optimization resulted in the identification of 4-oxo-2-thioxo-thiazolidinone derivative 9 as a selective and direct small-molecule inhibitor of NLRP3 with IC50 of 2.4 μM, possessing favorable ex vivo and in vivo pharmacokinetic properties. Compound 9 may represent a lead for the development of anti-inflammatory therapeutics for treating NLRP3-driven diseases.